Basic information
- CAS
58290-35-0- Standard SMILES
COc1ccc(CSC[C@@H](NC(=O)OC(C)(C)C)C(=O)O)cc1- InChIKey
VRTXRNJMNFVTOM-CYBMUJFWSA-N- Molecular formula
- C16H23NO5S
- Average molar mass
- 341.4 g/mol
- Monoisotopic mass
- 341.12969401
Names & identifiers
- Preferred name
- N-[(1,1-Dimethylethoxy)carbonyl]-S-[(4-methoxyphenyl)methyl]-D-cysteine
- IUPAC
- (2S)-3-[(4-methoxyphenyl)methylsulfanyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
- English name
- Boc-S-4-methoxybenzyl-D-cysteine
- Molecular formula
- C16H23NO5S
- Molecular weight
- 341.42
Names & synonyms
58290-35-0N-[(1,1-Dimethylethoxy)carbonyl]-S-[(4-methoxyphenyl)methyl]-D-cysteineN-((1,1-Dimethylethoxy)carbonyl)-S-((4-methoxyphenyl)methyl)-D-cysteineRefChem:359516Boc-S-4-methoxybenzyl-D-cysteineBoc-D-Cys(pMeOBzl)-OHBoc-D-Cys(Mob)-OHBoc-D-Cys(4-MeO-Bzl)-OHMFCD00076922N-(Tert-Butoxycarbonyl)-S-(4-Methoxybenzyl)-D-CysteineBoc-Cys(Mob)-OHBoc-D-Cys(MeOBzl)-OH
Show more names
Boc-Cys(pMeOBzl)-OH(Tert-Butoxy)Carbonyl D-Cys(pMeOBzl)-OHN-Boc-S-(4-Methoxybenzyl)-D-cysteine, 95%Boc-S-4-methoxybenzyl-D-cysteine USP/EP/BPBoc-S-4-methoxybenzyl-D-cysteine≥ 98% (HPLC)Boc-D-Cys(4-Mob)-OH Boc-S-4-Methoxybenzyl-D-cysteineN-alpha-t-Butyloxycarbonyl-S-(4-methoxy-benzyl)-D-cysteine(R)-2-(Tert-butoxycarbonylamino)-3-(4-methoxybenzylthio)propanoic acid
SCHEMBL11331399VRTXRNJMNFVTOM-CYBMUJFWSA-NDTXSID101152879(2S)-3-[(4-methoxyphenyl)methylsulfanyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acidN-Boc-S-4-methoxybenzyl-D-cysteineBoc-S-(4-methoxybenzyl)-D-cysteineAKOS016842912FD21260
Database identifiers
- CAS
58290-35-0- PubChem CID
- 6992555
- DTXSID
DTXSID101152879
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 388
Physicochemical properties
- Boiling point
- 514 · 514.0±50.0 °C(Predicted)
- Density
- 1.205 · 1.205±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Sealed in dry,2-8°C
- pka
- 3.57 · 3.57±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers35 total
北京华美互利生物化工010-56205725 · [email protected]
江苏吉泰肽业科技有限公司18936337900 18936337900 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海安化生物技术有限公司021-61263375 18168859245
凯试(上海)科技有限公司021-50135380 · [email protected]
Shanghai Hanhong Scientific Co., Ltd.+undefined17612118332 · [email protected]
无锡亚肽生物科技有限公司0510-83583050 13771062561 · [email protected]
北京建强伟业科技有限公司（FUSION弗珍试剂品牌）0531-88924771 15614660963 · [email protected]
上海珈得尔化学技术有限公司13564435016 13564435016 · [email protected]
上海吉尔多肽有限公司+86-21-61263310 13764994101 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
GL Biochem (Shanghai) Ltd.+86-021-61263370 +86-18901917034
上海研纷生化科技有限公司17721070236 13611955358 · [email protected]
吉尔多肽生物制药（大连市）有限公司021-61263455 13167021076 · [email protected]
嘉兴市德亿化工有限公司86-0573-85866609 18367600069 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
上海皑博生物科技有限公司+86-21-37621270 · [email protected]
范德(北京)生物科技有限责任公司15911056312 · [email protected]
滨海吉尔多肽有限公司021-61263389 13524856427 · [email protected]
江苏洪珉药业有限公司18221292452 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
无锡迈默拓普生物科技有限公司15061806929 · [email protected]
郑州汇聚化工有限公司037155153829 18003835034 · [email protected]
四川嘉瑛莱科技有限责任公司028-64159575 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
重庆卡兰医药有限公司[email protected]
宝鸡缔都医药化工有限公司029-029-81148929 17792602132 · [email protected]
DONBOO AMINO ACID COMPANY13063595538 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
浙江昂拓莱司生物技术有限公司0571-88760729 18072970094 · [email protected]
Related reactions
10 records
Compound notes
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